2-(5-naphthalen-2-yl-1H-imidazol-2-yl)pentan-2-amine

C18H21N3 — CID 60849093

IUPAC2-(5-naphthalen-2-yl-1H-imidazol-2-yl)pentan-2-amine
SMILESCCCC(C)(N)c1ncc(-c2ccc3ccccc3c2)[nH]1
InChIInChI=1S/C18H21N3/c1-3-10-18(2,19)17-20-12-16(21-17)15-9-8-13-6-4-5-7-14(13)11-15/h4-9,11-12H,3,10,19H2,1-2H3,(H,20,21)
InChIKeyZFNGYXJPOGSFBE-UHFFFAOYSA-N
MW279.39 g/mol
LogP4.20
Rot. Bonds4

About 2-(5-naphthalen-2-yl-1H-imidazol-2-yl)pentan-2-amine

2-(5-naphthalen-2-yl-1H-imidazol-2-yl)pentan-2-amine (PubChem CID 60849093) has the molecular formula C18H21N3 and a molecular weight of 279.39 g/mol. Its IUPAC name is 2-(5-naphthalen-2-yl-1H-imidazol-2-yl)pentan-2-amine.

Molecular Properties

Compound Name2-(5-naphthalen-2-yl-1H-imidazol-2-yl)pentan-2-amine
PubChem CID60849093
Molecular FormulaC18H21N3
Molecular Weight279.39 g/mol
Exact Mass279.17
IUPAC Name2-(5-naphthalen-2-yl-1H-imidazol-2-yl)pentan-2-amine
SMILESCCCC(C)(N)c1ncc(-c2ccc3ccccc3c2)[nH]1
InChIInChI=1S/C18H21N3/c1-3-10-18(2,19)17-20-12-16(21-17)15-9-8-13-6-4-5-7-14(13)11-15/h4-9,11-12H,3,10,19H2,1-2H3,(H,20,21)
InChIKeyZFNGYXJPOGSFBE-UHFFFAOYSA-N
XLogP4.20
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.39
LogP ≤ 54.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(5-naphthalen-2-yl-1H-imidazol-2-yl)pentan-2-amine?
The IUPAC name of 2-(5-naphthalen-2-yl-1H-imidazol-2-yl)pentan-2-amine (CID 60849093) is 2-(5-naphthalen-2-yl-1H-imidazol-2-yl)pentan-2-amine.
What is the SMILES notation for 2-(5-naphthalen-2-yl-1H-imidazol-2-yl)pentan-2-amine?
The canonical SMILES for 2-(5-naphthalen-2-yl-1H-imidazol-2-yl)pentan-2-amine is CCCC(C)(N)c1ncc(-c2ccc3ccccc3c2)[nH]1.
What is the InChIKey of 2-(5-naphthalen-2-yl-1H-imidazol-2-yl)pentan-2-amine?
The InChIKey is ZFNGYXJPOGSFBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3/c1-3-10-18(2,19)17-20-12-16(21-17)15-9-8-13-6-4-5-7-14(13)11-15/h4-9,11-12H,3,10,19H2,1-2H3,(H,20,21).
What are the key properties of 2-(5-naphthalen-2-yl-1H-imidazol-2-yl)pentan-2-amine?
2-(5-naphthalen-2-yl-1H-imidazol-2-yl)pentan-2-amine has a molecular weight of 279.39 g/mol, XLogP of 4.20, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-naphthalen-2-yl-1H-imidazol-2-yl)pentan-2-amine is sourced from PubChem (CID 60849093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).